<br><br><div class="gmail_quote">---------- Forwarded message ----------<br>From: <b class="gmail_sendername">shamik chakrabarti</b> <span dir="ltr"><<a href="mailto:shamikphy@gmail.com">shamikphy@gmail.com</a>></span><br>
Date: Sun, May 29, 2011 at 10:03 PM<br>Subject: error during DOS calculation<br>To: A Mailing list for WIEN2k users <<a href="mailto:wien@zeus.theochem.tuwien.ac.at">wien@zeus.theochem.tuwien.ac.at</a>><br><br><br><div>
Dear wien2k users,</div><div><br></div><div> We have run one spin polarize calculation on FeCrVAl. After completion of SCF cycle when we tried to plot DOS we got the following error message:: </div>
<div><br></div>/usr/local/Wien2K/lapw2c: /opt/intel/mkl/<a href="http://10.2.1.017/lib/em64t/libiomp5.so" target="_blank">10.2.1.017/lib/em64t/libiomp5.so</a>: no version information available (required by /usr/local/Wien2K/lapw2c)<br>
forrtl: severe (67): input statement requires too much data, unit 10, file /home/sudhir/wien_computes/FeCr1VAl_SP/./FeCr1VAl_SP.vectorup<br>
Image PC Routine Line Source <br>lapw2c 00000000005121ED Unknown Unknown Unknown<br>lapw2c 0000000000510CF5 Unknown Unknown Unknown<br>
lapw2c 00000000004BCC89 Unknown Unknown Unknown<br>lapw2c 000000000047970D Unknown Unknown Unknown<br>lapw2c 0000000000478F5A Unknown Unknown Unknown<br>
lapw2c 0000000000494377 Unknown Unknown Unknown<br>lapw2c 000000000049205A Unknown Unknown Unknown<br>lapw2c 000000000046B112 read_vec_ 152 read_vec_tmp_.F<br>
lapw2c 000000000044A324 l2main_ 508 l2main_tmp_.F<br>lapw2c 000000000045CF4E MAIN__ 543 lapw2_tmp_.F<br>lapw2c 000000000040359C Unknown Unknown Unknown<br>
libc.so.6 0000003343E1EA4D Unknown Unknown Unknown<br>lapw2c 0000000000403499 Unknown Unknown Unknown<br>0.238u 0.186s 0:00.39 105.1% 0+0k 0+4288io 0pf+0w<br>error: command /usr/local/Wien2K/lapw2c uplapw2.def failed<br>
<br><div>Only in this calculation this error is appearing. We have also calculated FeMnVAl and in that case no errors appeared during DOS calculation. Any response in this regard will be very helpful for us. Thank you in advance.</div>
<div><br></div><div>with regards,<br clear="all"><br>-- <br>Shamik Chakrabarti<br>Research Scholar<br>Dept. of Physics & Meteorology<br>Material Processing & Solid State Ionics Lab<br>IIT Kharagpur<br>Kharagpur 721302<br>
INDIA<br>
</div>
</div><br><br clear="all"><br>-- <br>Shamik Chakrabarti<br>Research Scholar<br>Dept. of Physics & Meteorology<br>Material Processing & Solid State Ionics Lab<br>IIT Kharagpur<br>Kharagpur 721302<br>INDIA<br>